| PDB CCD ID: | WXO |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C13 H16 N4 O4 S |
| InChI: | InChI=1S/C13H16N4O4S/c18-12-10-7-9(8-14-11(10)15-13(19)16-12)22(20,21)17-5-3-1-2-4-6-17/h7-8H,1-6H2,(H2,14,15,16,18,19) |
| InChIKey: | LLNQFWFHQRNMTN-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | O=C1NC(=O)c2cc(cnc2N1)[S](=O)(=O)N3CCCCCC3 | | OpenEye OEToolkits 2.0.7 | c1c(cnc2c1C(=O)NC(=O)N2)S(=O)(=O)N3CCCCCC3 | | ACDLabs 12.01 | O=S(=O)(c1cc2C(=O)NC(=O)Nc2nc1)N1CCCCCC1 |
|
| Name: | 6-(azepane-1-sulfonyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione |
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